AE62503
1261949-21-6 | 3-Cyano-5-(4-cyanophenyl)phenol
Manufacturer: A2B Chem
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CatalogNumber
AE62503
ChemicalName
3-Cyano-5-(4-cyanophenyl)phenol
CasNumber
1261949-21-6
MolecularFormula
C14H8N2O
MolecularWeight
220.2261
MdlNumber
MFCD18314170
Smiles
N#Cc1ccc(cc1)c1cc(O)cc(c1)C#N
Complexity
353
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.6
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CatalogNumber: AE62503
ChemicalName: 3-Cyano-5-(4-cyanophenyl)phenol
CasNumber: 1261949-21-6
MolecularFormula: C14H8N2O
MolecularWeight: 220.2261
MdlNumber: MFCD18314170
Smiles: N#Cc1ccc(cc1)c1cc(O)cc(c1)C#N
Complexity: 353
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AE62503
ChemicalName:
3-Cyano-5-(4-cyanophenyl)phenol
CasNumber:
1261949-21-6
MolecularFormula:
C14H8N2O
MolecularWeight:
220.2261
MdlNumber:
MFCD18314170
Smiles:
N#Cc1ccc(cc1)c1cc(O)cc(c1)C#N
Complexity:
353
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: AE62504
ChemicalName: 3-(4-Cyano-3-fluorophenyl)benzoic acid
CasNumber: 1393441-83-2
MolecularFormula: C14H8FNO2
MolecularWeight: 241.2172
MdlNumber: MFCD22383718
Smiles: N#Cc1ccc(cc1F)c1cccc(c1)C(=O)O
Complexity: 362
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 2.9
CatalogNumber:
AE62504
ChemicalName:
3-(4-Cyano-3-fluorophenyl)benzoic acid
CasNumber:
1393441-83-2
MolecularFormula:
C14H8FNO2
MolecularWeight:
241.2172
MdlNumber:
MFCD22383718
Smiles:
N#Cc1ccc(cc1F)c1cccc(c1)C(=O)O
Complexity:
362
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
2.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: N#Cc1c(F)cccc1c1cccc(c1C#N)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
N#Cc1c(F)cccc1c1cccc(c1C#N)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AE62506
ChemicalName: 2-Cyano-4-(4-hydroxyphenyl)phenol
CasNumber: 1261973-27-6
MolecularFormula: C13H9NO2
MolecularWeight: 211.2161
MdlNumber: MFCD18314157
Smiles: N#Cc1cc(ccc1O)c1ccc(cc1)O
Complexity: 275
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 3.1
CatalogNumber:
AE62506
ChemicalName:
2-Cyano-4-(4-hydroxyphenyl)phenol
CasNumber:
1261973-27-6
MolecularFormula:
C13H9NO2
MolecularWeight:
211.2161
MdlNumber:
MFCD18314157
Smiles:
N#Cc1cc(ccc1O)c1ccc(cc1)O
Complexity:
275
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
3.1